2-methoxyethyl 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate

Systemtic Name: 2-methoxyethyl 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxidanylidene-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Openeye Name: 2-methoxyethyl 2-[(5E)-5-[(4-nitrophenyl)methylene]-4-oxo-2-thioxo-thiazolidin-3-yl]propanoate CAS Name: 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-3-thiazolidinyl]propanoic acid 2-methoxyethyl ester IUPAC Name: 2-methoxyethyl 2-[(5E)-5-[(4-nitrophenyl)methylidene]-4-oxo-2-sulfanylidene-1,3-thiazolidin-3-yl]propanoate Traditional Name: 2-[(5E)-4-keto-5-(4-nitrobenzylidene)-2-thioxo-thiazolidin-3-yl]propionic acid 2-methoxyethyl ester Formula: C16H16N2O6S2 MolecularWeight: 396.43804

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OCCOC)N1C(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])SC1=S

Isomeric SMILES

CC(C(=O)OCCOC)N1C(=O)/C(=C\C2=CC=C(C=C2)[N+](=O)[O-])/SC1=S

InChI

InChI=1S/C16H16N2O6S2/c1-10(15(20)24-8-7-23-2)17-14(19)13(26-16(17)25)9-11-3-5-12(6-4-11)18(21)22/h3-6,9-10H,7-8H2,1-2H3/b13-9+